1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one

C22H26FN3O4 — CID 10194524

IUPAC1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one
SMILESCOc1ccc(N2CCN(c3cccc(F)c3)C2=O)cc1OCCN1CCOCC1
InChIInChI=1S/C22H26FN3O4/c1-28-20-6-5-19(16-21(20)30-14-11-24-9-12-29-13-10-24)26-8-7-25(22(26)27)18-4-2-3-17(23)15-18/h2-6,15-16H,7-14H2,1H3
InChIKeyFDRKHYTUOYAXAY-UHFFFAOYSA-N
MW415.47 g/mol
LogP2.99
Rot. Bonds7

About 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one

1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one (PubChem CID 10194524) has the molecular formula C22H26FN3O4 and a molecular weight of 415.47 g/mol. Its IUPAC name is 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one.

Molecular Properties

Compound Name1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one
PubChem CID10194524
Molecular FormulaC22H26FN3O4
Molecular Weight415.47 g/mol
Exact Mass415.19
IUPAC Name1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one
SMILESCOc1ccc(N2CCN(c3cccc(F)c3)C2=O)cc1OCCN1CCOCC1
InChIInChI=1S/C22H26FN3O4/c1-28-20-6-5-19(16-21(20)30-14-11-24-9-12-29-13-10-24)26-8-7-25(22(26)27)18-4-2-3-17(23)15-18/h2-6,15-16H,7-14H2,1H3
InChIKeyFDRKHYTUOYAXAY-UHFFFAOYSA-N
XLogP2.99
TPSA54.48 Ų
H-Bond Donors
H-Bond Acceptors5
Rotatable Bonds7
Heavy Atoms30
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500415.47
LogP ≤ 52.99
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one?
The IUPAC name of 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one (CID 10194524) is 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one.
What is the SMILES notation for 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one?
The canonical SMILES for 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one is COc1ccc(N2CCN(c3cccc(F)c3)C2=O)cc1OCCN1CCOCC1.
What is the InChIKey of 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one?
The InChIKey is FDRKHYTUOYAXAY-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H26FN3O4/c1-28-20-6-5-19(16-21(20)30-14-11-24-9-12-29-13-10-24)26-8-7-25(22(26)27)18-4-2-3-17(23)15-18/h2-6,15-16H,7-14H2,1H3.
What are the key properties of 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one?
1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one has a molecular weight of 415.47 g/mol, XLogP of 2.99, 7 rotatable bonds, 0 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(3-fluorophenyl)-3-[4-methoxy-3-(2-morpholin-4-ylethoxy)phenyl]imidazolidin-2-one is sourced from PubChem (CID 10194524), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).